N-(2-methoxy-5-nitro-phenyl)-5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-5-methyl-4-oxo-3-propyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(2-methoxy-5-nitrophenyl)-5-methyl-4-oxo-3-propyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-5-methyl-4-oxo-3-propylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-keto-N-(2-methoxy-5-nitro-phenyl)-5-methyl-3-propyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC)C

Isomeric SMILES

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC)C

InChI

InChI=1S/C18H18N4O5S/c1-4-7-21-9-19-17-14(18(21)24)10(2)15(28-17)16(23)20-12-8-11(22(25)26)5-6-13(12)27-3/h5-6,8-9H,4,7H2,1-3H3,(H,20,23)